(4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone
TL;DR: (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone (CAS 433702-51-3) is a chemical compound with molecular formula C21H25N3O3 and molecular weight 367.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone
Also Known As: (4-tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone, A3145/0132942, (4-tert-butylphenyl)[4-(2-nitrophenyl)piperazin-1-yl]methanone, [4-(TERT-BUTYL)PHENYL][4-(2-NITROPHENYL)PIPERAZINO]METHANONE, Cambridge id 6945769
| Molecular Formula | C21H25N3O3 |
|---|---|
| Molecular Weight | 367.19 g/mol |
| LogP | 3.8547 |
| Topological Polar Surface Area | 66.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 367.1896 |
| Heavy Atoms | 27 |
| Complexity | 832.4955 |
Chemical Identifiers
| CAS Number | 433702-51-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-] |
Product Overview
(4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone (CAS 433702-51-3), with molecular formula C21H25N3O3 and molecular weight 367.19 g/mol. IUPAC: (4-tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone.
Chemical Property Profile of (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone
Property Insights of (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone
The XLogP value of 3.8547 indicates that (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.69 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone. Following Lipinski's Rule of Five, (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone?
The CAS number of (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone is 433702-51-3.
What is the molecular formula of (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone?
The molecular formula of (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone is C21H25N3O3.
What is the molecular weight of (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone?
The molecular weight of (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone is 367.19 g/mol.
Where can I buy (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone?
You can request a quote for (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for (4-Tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.